BD3R1N -OEChem-04022103073D 41 44 0 0 0 0 0 0 0999 V2000 -4.2435 2.1441 0.0009 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7131 1.1462 0.0008 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4420 -1.6538 -0.0008 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7730 -1.9214 -0.0008 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1458 0.0095 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5077 0.5458 0.0006 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3747 -0.8268 -0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6162 1.4540 0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9039 -1.5000 -0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7716 0.3131 0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6566 -1.0673 -0.0005 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1591 1.8923 1.2081 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1579 1.8931 -1.2079 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5214 -1.8247 -1.2081 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5207 -1.8257 1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7855 3.2081 -0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3721 -2.8002 0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2437 2.7692 1.2079 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2425 2.7700 -1.2081 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7555 -2.4747 -1.2079 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7547 -2.4757 1.2081 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1080 0.9271 0.0005 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9452 4.1454 -0.0005 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6915 -3.4949 0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9339 -1.3528 -0.0006 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7479 1.5602 2.1585 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7457 1.5616 -2.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0535 -1.5786 -2.1584 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0522 -1.5804 2.1583 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6569 3.1048 2.1555 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6547 3.1062 -2.1559 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2257 -2.7238 -2.1555 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2244 -2.7255 2.1558 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5787 3.9906 0.8795 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5779 3.9911 -0.8812 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5912 5.1811 -0.0001 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5450 -4.5796 -0.0004 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2829 -3.2202 -0.8799 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2824 -3.2209 0.8808 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0999 0.3582 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8653 -1.9389 -0.0008 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 2 0 0 0 0 2 6 2 0 0 0 0 2 10 1 0 0 0 0 3 7 2 0 0 0 0 3 11 1 0 0 0 0 4 11 1 0 0 0 0 4 25 2 0 0 0 0 5 22 1 0 0 0 0 5 25 1 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 9 1 0 0 0 0 8 12 2 0 0 0 0 8 13 1 0 0 0 0 9 14 2 0 0 0 0 9 15 1 0 0 0 0 10 11 2 0 0 0 0 10 22 1 0 0 0 0 12 18 1 0 0 0 0 12 26 1 0 0 0 0 13 19 2 0 0 0 0 13 27 1 0 0 0 0 14 20 1 0 0 0 0 14 28 1 0 0 0 0 15 21 2 0 0 0 0 15 29 1 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 16 23 1 0 0 0 0 17 20 2 0 0 0 0 17 21 1 0 0 0 0 17 24 1 0 0 0 0 18 30 1 0 0 0 0 19 31 1 0 0 0 0 20 32 1 0 0 0 0 21 33 1 0 0 0 0 23 34 1 0 0 0 0 23 35 1 0 0 0 0 23 36 1 0 0 0 0 24 37 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 25 41 1 0 0 0 0 M END $$$$